[(3R,5S)-5-(6-methoxypyridin-2-yl)-1-(phenylmethyl)piperidin-3-yl]methyl methanesulfonate

Systemtic Name: [(3R,5S)-5-(6-methoxypyridin-2-yl)-1-(phenylmethyl)piperidin-3-yl]methyl methanesulfonate Openeye Name: [(3R,5S)-1-benzyl-5-(6-methoxy-2-pyridyl)-3-piperidyl]methyl methanesulfonate CAS Name: methanesulfonic acid [(3R,5S)-5-(6-methoxy-2-pyridinyl)-1-(phenylmethyl)-3-piperidinyl]methyl ester IUPAC Name: [(3R,5S)-1-benzyl-5-(6-methoxypyridin-2-yl)piperidin-3-yl]methyl methanesulfonate Traditional Name: methanesulfonic acid [(3R,5S)-1-benzyl-5-(6-methoxy-2-pyridyl)-3-piperidyl]methyl ester Formula: C20H26N2O4S MolecularWeight: 390.49644

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=N1)C2CC(CN(C2)CC3=CC=CC=C3)COS(=O)(=O)C

Isomeric SMILES

COC1=CC=CC(=N1)[C@H]2C[C@H](CN(C2)CC3=CC=CC=C3)COS(=O)(=O)C

InChI

InChI=1S/C20H26N2O4S/c1-25-20-10-6-9-19(21-20)18-11-17(15-26-27(2,23)24)13-22(14-18)12-16-7-4-3-5-8-16/h3-10,17-18H,11-15H2,1-2H3/t17-,18+/m1/s1